2-[4-(4-heptylphenyl)phenyl]-5-pentyl-1,4-dioxane

Systemtic Name: 2-[4-(4-heptylphenyl)phenyl]-5-pentyl-1,4-dioxane Openeye Name: 2-[4-(4-heptylphenyl)phenyl]-5-pentyl-1,4-dioxane CAS Name: 2-[4-(4-heptylphenyl)phenyl]-5-pentyl-1,4-dioxane IUPAC Name: 2-[4-(4-heptylphenyl)phenyl]-5-pentyl-1,4-dioxane Traditional Name: 2-amyl-5-[4-(4-heptylphenyl)phenyl]-1,4-dioxane Formula: C28H40O2 MolecularWeight: 408.616

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3COC(CO3)CCCCC

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3COC(CO3)CCCCC

InChI

InChI=1S/C28H40O2/c1-3-5-7-8-10-11-23-13-15-24(16-14-23)25-17-19-26(20-18-25)28-22-29-27(21-30-28)12-9-6-4-2/h13-20,27-28H,3-12,21-22H2,1-2H3